PENERAPANMETODE FINITE DIFFERENCE TIME DOMAIN (FDTD) PADA DENSITY FUNCTIONAL THEORY (DFT) DENGAN PENDEKATAN DENSITAS LOKAL
| Main Author: | ADJIE SATRYO PAMUNGKAS, ADJIE SATRYO PAMUNGKAS |
|---|---|
| Format: | Thesis NonPeerReviewed Book |
| Bahasa: | eng |
| Terbitan: |
, 2018
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| Subjects: | |
| Online Access: |
http://eprints.unram.ac.id/6088/1/JURNAL%20ADJIE%20SATRYO%20PAMUNGKAS%20%5BG1B014002%5D.pdf http://eprints.unram.ac.id/6088/ |
Daftar Isi:
- Abstract. Density functional theory (DFT) has been used very successful to obtain electronic structures of atoms and molecules. One method to obtain ground state densities and energies using the DFT method is by solving the time-dependent Kohn Sham (TDKS) equation. In this paper we apply the finite difference time domain (FDTD) method to solve the TDKS equation in imaginary time. The FDTD-DFT method is given in this paper and its numerical results for ground states and energies for various atoms and molecules